1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine

C10H18N4 — CID 64667693

IUPAC1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine
SMILESCCCn1cnnc1C(C)(N)C1CC1
InChIInChI=1S/C10H18N4/c1-3-6-14-7-12-13-9(14)10(2,11)8-4-5-8/h7-8H,3-6,11H2,1-2H3
InChIKeyOUDZDXDZBUXIDO-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.27
Rot. Bonds4

About 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine

1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine (PubChem CID 64667693) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine
PubChem CID64667693
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine
SMILESCCCn1cnnc1C(C)(N)C1CC1
InChIInChI=1S/C10H18N4/c1-3-6-14-7-12-13-9(14)10(2,11)8-4-5-8/h7-8H,3-6,11H2,1-2H3
InChIKeyOUDZDXDZBUXIDO-UHFFFAOYSA-N
XLogP1.27
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine?
The IUPAC name of 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine (CID 64667693) is 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine.
What is the SMILES notation for 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine?
The canonical SMILES for 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine is CCCn1cnnc1C(C)(N)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine?
The InChIKey is OUDZDXDZBUXIDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-3-6-14-7-12-13-9(14)10(2,11)8-4-5-8/h7-8H,3-6,11H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine?
1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine has a molecular weight of 194.28 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(4-propyl-1,2,4-triazol-3-yl)ethanamine is sourced from PubChem (CID 64667693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).